Score combining binding energy and permeability.
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* ΔGb are energy values in kcal/mol using the MM/GBSA method (Table 3).† S+Peff is the human jejunal effective permeability expressed in 104 cm/s.‡ The score is calculated based on a function combining the effect of binding energy and permeability.§ IC50 is the average IC50 in nM for the breast cancer cell lines (Table 1).Score combining binding energy and permeability.
创建时间：
2015-12-03
